SCHEMBL7064034

SCHEMBL7064034

C=CCOC(=O)Cc1ccncc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 14/20 0.54
SNCA P37840 1/20 0.51
CYP3A4 P08684 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
PKM P14618 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17386357 0.87 CYP3A4 (0.50) CYP3A4NPSR1SMN1; SMN2PKMALDH1A1
SCHEMBL29620611 0.82 CYP3A4 (0.46) CYP3A4NPSR1SMN1; SMN2PKMALDH1A1
SCHEMBL203679 0.82 ALDH1A1 (0.61) CYP3A4NPSR1SMN1; SMN2PKMALDH1A1
SCHEMBL9280186 0.81 NAPRT (0.54) CYP19A1CYP3A4NPSR1
Hydrochloric Acid SCHEMBL25259767 0.81 ALDH1A1 (0.59) CYP3A4NPSR1SMN1; SMN2PKMALDH1A1
SCHEMBL5687587 0.81 CA2 (0.47) CYP3A4NPSR1SMN1; SMN2PKMALDH1A1
SCHEMBL5322788 0.79 SMN1; SMN2 (0.53) CYP3A4NPSR1SMN1; SMN2PKMALDH1A1
SCHEMBL18996987 0.79 ALDH1A1 (0.45) CYP3A4NPSR1SMN1; SMN2PKMALDH1A1
SCHEMBL5688510 0.79 ALDH1A1 (0.47) CYP3A4NPSR1SMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL29034764 0.79 CYP3A4 (0.43) CYP3A4NPSR1SMN1; SMN2PKMALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0334633-B1 PREPARATION OF 2,6-DIOXOPIPERIDINE DERIVATIVES BTG INTERNATIONAL LIMITED (GB) 1993-05-12 EP claimed
US-5112976-A PREPARATION OF 2,6-DIOXOPIPERIDINE DERIVATIVES NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1992-05-12 US claimed
WO-1989009216-A1 PREPARATION OF 2,6-DIOXOPIPERIDINE DERIVATIVES NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1989-10-05 WO claimed
EP-0334633-A1 Preparation of 2,6-Dioxopiperidine derivatives BTG INTERNATIONAL LIMITED (GB) 1989-09-27 EP claimed
US-6677268-B2 A METAL COMPLEXES AS HYDROFORMYLATION CATALYST OF OLEFINICALLY UNSATURATED COMPOUNDS INSTITUT FRANCAIS DU PETROLE (FR) 2004-01-13 US disclosed
US-20030055299-A1 Catalyst based on cobalt and/or rhodium employed in a two-phase medium INSTITUT FRANCAIS DU PETROLE (FR) 2003-03-20 US disclosed
US-6469216-B2 CO OR RH COMPLEX COORDINATED WITH A NITROGEN-CONTAINING LIGAND; QUATERNARY AMMONIUM OR PHOSPHONIUM IONIC SOLVENT INSTITUT FRANCAIS DU PETROLE (FR) 2002-10-22 US disclosed
EP-1157007-A1 PDE IV INHIBITING COMPOUNDS, COMPOSITIONS AND METHODS OF TREATMENT MERCK FROSST CANADA INC. (CA) 2001-11-28 EP disclosed
US-20010039363-A1 Process for hydroformylation using a catalyst based on cobalt and/or rhodium employed in a two-phase medium INSTITUT FRANCAIS DU PETROLE (FR) 2001-11-08 US disclosed
US-6204275-B1 PDE IV inhibiting compounds, compositions and methods of treatment MERCK FROSST CANADA & CO. (CA) 2001-03-20 US disclosed
WO-2000050402-A1 PDE IV INHIBITING COMPOUNDS, COMPOSITIONS AND METHODS OF TREATMENT MERCK FROSST CANADA & CO. (CA) 2000-08-31 WO disclosed
US-5661014-A Chiral compounds and their resolution synthesis using enantioselective esterases CHIROSCIENCE LIMITED (GB) 1997-08-26 US disclosed
EP-0599959-A1 CHIRAL GLUTARATE ESTERS, THEIR RESOLUTION AND DERIVED GLUTARIMIDE COMPOUNDS Chiroscience Limited (GB) 1994-06-08 EP disclosed
EP-0334633-B1 PREPARATION OF 2,6-DIOXOPIPERIDINE DERIVATIVES BTG INTERNATIONAL LIMITED (GB) 1993-05-12 EP disclosed
WO-1993004058-A1 CHIRAL GLUTARATE ESTERS, THEIR RESOLUTION AND DERIVED GLUTARIMIDE COMPOUNDS CHIROSCIENCE LIMITED (GB) 1993-03-04 WO disclosed
US-5112976-A PREPARATION OF 2,6-DIOXOPIPERIDINE DERIVATIVES NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1992-05-12 US disclosed
WO-1989009216-A1 PREPARATION OF 2,6-DIOXOPIPERIDINE DERIVATIVES NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1989-10-05 WO disclosed
EP-0334633-A1 Preparation of 2,6-Dioxopiperidine derivatives BTG INTERNATIONAL LIMITED (GB) 1989-09-27 EP disclosed